Vitas-M small molecule compound
ethyl 5-benzyl-2-({[4-(4-hydroxyphenyl)piperazin-1-yl]carbonothioyl}amino)thiophene-3-carboxylate
Catalog ID
STK446439
SMILES CCOC(=O)c1cc(sc1NC(=S)N1CCN(CC1)c1ccc(cc1)O)Cc1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H27N3O3S2 MW 481.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O3S2/c1-2-31-24(30)22-17-21(16-18-6-4-3-5-7-18)33-23(22)26-25(32)28-14-12-27(13-15-28)19-8-10-20(29)11-9-19/h3-11,17,29H,2,12-16H2,1H3,(H,26,32)InChIKey
YVEUNQWAKUVCKN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)N3CCN(CC3)C4=CC=C(C=C4)O
ETHYL2(((4(4HYDROXYPHENYL)PIPERAZINYL)THIOXOMETHYL)AMINO)5BENZYLTHIOPHENE3CARBOXYLATE
ethyl5benzyl2(((4(4hydroxyphenyl)piperazin1yl)carbonothioyl)amino)thiophene3carboxylate
ethyl5benzyl2((4(4hydroxyphenyl)piperazine1carbothioyl)amino)thiophene3carboxylate
InChI=1SC25H27N3O3S2c123124(30)221721(16186435718)3323(22)2625(32)28141227(131528)1981020(29)11919h3111729H21216H21H3(H2632)
MFCD04058618
ZINC000020168651
ZINC20168651
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